3-[[3-[[2-(1-naphthalen-1-ylethylamino)phenyl]methyl]phenyl]amino]-4-oxidanyl-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[3-[[2-(1-naphthalen-1-ylethylamino)phenyl]methyl]phenyl]amino]-4-oxidanyl-cyclobut-3-ene-1,2-dione Openeye Name: 3-hydroxy-4-[3-[[2-[1-(1-naphthyl)ethylamino]phenyl]methyl]anilino]cyclobut-3-ene-1,2-dione CAS Name: 3-hydroxy-4-[3-[[2-[1-(1-naphthalenyl)ethylamino]phenyl]methyl]anilino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-hydroxy-4-[3-[[2-(1-naphthalen-1-ylethylamino)phenyl]methyl]anilino]cyclobut-3-ene-1,2-dione Traditional Name: 3-hydroxy-4-[3-[2-[1-(1-naphthyl)ethylamino]benzyl]anilino]cyclobut-3-ene-1,2-quinone Formula: C29H24N2O3 MolecularWeight: 448.51246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC3=CC=CC=C3CC4=CC(=CC=C4)NC5=C(C(=O)C5=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC3=CC=CC=C3CC4=CC(=CC=C4)NC5=C(C(=O)C5=O)O

InChI

InChI=1S/C29H24N2O3/c1-18(23-14-7-11-20-9-2-4-13-24(20)23)30-25-15-5-3-10-21(25)16-19-8-6-12-22(17-19)31-26-27(32)29(34)28(26)33/h2-15,17-18,30-32H,16H2,1H3